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· · COA & SDS available for every product · Same-day shipping on in-stock items 6-(Methylthio)purine - ≥97% , CAS No.50-66-8
Synonyms
6-(Methylthio)-9H-purine | a thiopurine S-methylether | Purine, 6-methylthio- | BIDD:GT0117 | 6-(methylsulfanyl)-9H-purine | 6-Methylsulfanyl-9H-purine | BRD-K43675242-001-01-9 | 1H-Purine, 6-(methylthio)- | NCGC00081884-02 | FT-0671906 | HMS1526D02 | AB0
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Why this grade ≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C Ships Wet ice Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
6-(Methylthio)-9H-purine | a thiopurine S-methylether | Purine, 6-methylthio- | BIDD:GT0117 | 6-(methylsulfanyl)-9H-purine | 6-Methylsulfanyl-9H-purine | BRD-K43675242-001-01-9 | 1H-Purine, 6-(methylthio)- | NCGC00081884-02 | FT-0671906 | HMS1526D02 | AB0
Specifications & Purity
≥97%
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Pubchem Sid 504750937 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504750937 Canonical Smiles CSC1=NC=NC2=C1NC=N2 IUPAC Name 6-methylsulfanyl-7H-purine InChIKey UIJIQXGRFSPYQW-UHFFFAOYSA-N INCHI 1S/C6H6N4S/c1-11-6-4-5(8-2-7-4)9-3-10-6/h2-3H,1H3,(H,7,8,9,10) Isomeric SMILES CSC1=NC=NC2=C1NC=N2 Molecular Weight 166.206 Reaxy-Rn 7695 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7695&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Imidazopyrimidines Subclass Purines and purine derivatives Intermediate Tree Nodes Not available Direct Parent 6-thiopurines Alternative Parents Alkylarylthioethers Pyrimidines and pyrimidine derivatives Imidazoles Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 6-thiopurine - Aryl thioether - Alkylarylthioether - Pyrimidine - Azole - Imidazole - Heteroaromatic compound - Azacycle - Sulfenyl compound - Thioether - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organopnictogen compound - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as 6-thiopurines. These are compounds containing a purine that carries a thiol group at the 6-position. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring. External Descriptors thiopurine Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solubility Soluble in water (769 mg/L). Melt Point(°C) 220-223°C Molecular Weight 166.210 g/mol XLogP3 1.100 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 4 Rotatable Bond Count 1 Exact Mass 166.031 Da Monoisotopic Mass 166.031 Da Topological Polar Surface Area 79.800 Ų Heavy Atom Count 11 Formal Charge 0 Complexity 143.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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